[3-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-methylidene-butoxy]methylphosphonic acid

Systemtic Name: [3-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-methylidene-butoxy]methylphosphonic acid Openeye Name: [3-(2-amino-6-oxo-3H-purin-9-yl)-2-methylene-butoxy]methylphosphonic acid CAS Name: [3-(2-amino-6-oxo-3H-purin-9-yl)-2-methylenebutoxy]methylphosphonic acid IUPAC Name: [3-(2-amino-6-oxo-3H-purin-9-yl)-2-methylidenebutoxy]methylphosphonic acid Traditional Name: 2-[1-(2-amino-6-keto-3H-purin-9-yl)ethyl]allyloxymethylphosphonic acid Formula: C11H16N5O5P MolecularWeight: 329.249001

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=C)COCP(=O)(O)O)N1C=NC2=C1NC(=NC2=O)N

Isomeric SMILES

CC(C(=C)COCP(=O)(O)O)N1C=NC2=C1NC(=NC2=O)N

InChI

InChI=1S/C11H16N5O5P/c1-6(3-21-5-22(18,19)20)7(2)16-4-13-8-9(16)14-11(12)15-10(8)17/h4,7H,1,3,5H2,2H3,(H2,18,19,20)(H3,12,14,15,17)